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Substance Name: (1)Benzothieno(3,2-b)pyridine-3-carboxylic acid, 1,4-dihydro-2-methyl-4-phenyl-, methyl ester, 5,5-dioxide
RN: 105098-72-4
InChIKey: AESWWHCCYJCTGF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H17-N-O4-S

Molecular Weight

  • 367.4233
 
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Names and Synonyms

Synonym

  • 1-Phenyl-2-methoxycarbonyl-3-methyl-1,4-dihydrobenzothieno(3,2-b)pyridine-9,9-dioxide

Systematic Name

  • (1)Benzothieno(3,2-b)pyridine-3-carboxylic acid, 1,4-dihydro-2-methyl-4-phenyl-, methyl ester, 5,5-dioxide

Registry Numbers

CAS Registry Number

  • 105098-72-4

System Generated Number

  • 0105098724

Structure Descriptors

InChI

1S/C20H17NO4S/c1-12-16(20(22)25-2)17(13-8-4-3-5-9-13)19-18(21-12)14-10-6-7-11-15(14)26(19,23)24/h3-11,17,21H,1-2H3

InChIKey

AESWWHCCYJCTGF-UHFFFAOYSA-N

Smiles

CC1=C(C(C2=C(N1)c3ccccc3S2(=O)=O)c4ccccc4)C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 7gm/kg (7000mg/kg)   U.S.S.R. Patent Document. Vol. #1018396,